General Information of the Compound
| Compound ID |
CP0575502
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| Compound Name |
1-(3-chloro-4-methylphenyl)-N-cyclobutylpyrrolo[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C19H18ClN3O
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| Molecular Weight |
339.826
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| Canonical SMILES |
Cc1ccc(cc1Cl)-n1c(cc2cccnc12)C(=O)NC1CCC1
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| InChI |
InChI=1S/C19H18ClN3O/c1-12-7-8-15(11-16(12)20)23-17(19(24)22-14-5-2-6-14)10-13-4-3-9-21-18(13)23/h3-4,7-11,14H,2,5-6H2,1H3,(H,22,24)
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| InChIKey |
KWGHNMFHAYYUGT-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound